methyl (2S,3S)-8-bromanyl-3-methanoyl-6-methoxy-5-oxidanyl-4-oxidanylidene-3-(3-oxidanylidenebutyl)-1,2-dihydronaphthalene-2-carboxylate

Systemtic Name: methyl (2S,3S)-8-bromanyl-3-methanoyl-6-methoxy-5-oxidanyl-4-oxidanylidene-3-(3-oxidanylidenebutyl)-1,2-dihydronaphthalene-2-carboxylate Openeye Name: methyl (2S,3S)-8-bromo-3-formyl-5-hydroxy-6-methoxy-4-oxo-3-(3-oxobutyl)tetralin-2-carboxylate CAS Name: (2S,3S)-8-bromo-3-formyl-5-hydroxy-6-methoxy-4-oxo-3-(3-oxobutyl)-1,2-dihydronaphthalene-2-carboxylic acid methyl ester IUPAC Name: methyl (2S,3S)-8-bromo-3-formyl-5-hydroxy-6-methoxy-4-oxo-3-(3-oxobutyl)-1,2-dihydronaphthalene-2-carboxylate Traditional Name: (2S,3S)-8-bromo-3-formyl-5-hydroxy-4-keto-3-(3-ketobutyl)-6-methoxy-tetralin-2-carboxylic acid methyl ester Formula: C18H19BrO7 MolecularWeight: 427.24326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1(C(CC2=C(C=C(C(=C2C1=O)O)OC)Br)C(=O)OC)C=O

Isomeric SMILES

CC(=O)CC[C@]1([C@H](CC2=C(C=C(C(=C2C1=O)O)OC)Br)C(=O)OC)C=O

InChI

InChI=1S/C18H19BrO7/c1-9(21)4-5-18(8-20)11(17(24)26-3)6-10-12(19)7-13(25-2)15(22)14(10)16(18)23/h7-8,11,22H,4-6H2,1-3H3/t11-,18-/m1/s1